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Application

Discovery Studio 1.0 Materials Studio 0.6797911681531433 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.1006423982869379 Amorphous Cell 0.12027123483226267 Antibody 0.0 Blends 7.137758743754461E-4 CASTEP 0.34118486795146324 CDOCKER 0.244825124910778 CHARMm 0.2965738758029979 COMPASS 0.2651677373304782 COMPASS III 0.03461812990720914 COSMObase 0.0 COSMOconf 0.0 COSMOmic 0.0 COSMOperm 3.5688793718772306E-4 COSMOquick 7.137758743754461E-4 COSMOtherm 0.023197715917202 Catalyst 0.29514632405424696 Classical Simulations 0.8372591006423983 Conformers 0.0017844396859386152 Crystallization 0.11063526052819414 DFTB Plus 0.0053533190578158455 DMol3 0.1470378301213419 DPD 0.0017844396859386152 Discover 0.004282655246252677 Forcite 0.3654532476802284 GULP 0.012134189864382585 LUDI 0.008922198429693077 LibDock 0.06709493219129194 LigandFit 0.020342612419700215 MCSS 0.0032119914346895075 MODELER 0.13882940756602427 MesoDyn 0.0014275517487508922 Mesocite 0.0014275517487508922 Mesoscale 0.004996431120628123 Morphology 0.014989293361884369 Polymorph 0.0017844396859386152 QMERA 0.0 QSAR 0.0014275517487508922 Quantum Mechanics 0.4800142755174875 Reflex 0.09243397573162027 Reflex Plus 0.0032119914346895075 Semi-empirical 0.009635974304068522 Sorption 0.037116345467523196 Synthia 0.0014275517487508922 TURBOMOLE 0.0 VAMP 0.0035688793718772305 Visualization 1.0 X-Cell 0.0024982155603140615 ZDOCK 0.0053533190578158455

Year

2010 0.0030120481927710845 2011 0.024096385542168676 2012 0.030120481927710843 2013 0.03433734939759036 2014 0.03975903614457831 2015 0.0572289156626506 2016 0.06204819277108434 2017 0.0855421686746988 2018 0.11325301204819277 2019 0.13253012048192772 2020 0.24879518072289156 2021 0.34759036144578315 2022 0.5590361445783133 2023 0.7186746987951808 2024 1.0 2025 0.983132530120482 2026 0.31987951807228915 2027 0.0

Keywords

synthesized 1.0 target 0.9657261042990102 synthesis 0.36297828335056875 docking 0.3312158369035308 novel 0.2647362978283351 visualization 0.24316738070616042 potential 0.24287191608804845 compound 0.18968828482789185 activity 0.14344807209336682 analysis 0.1344364012409514 binding 0.09735559166789777 designed 0.08553700694341852 design 0.08066184074457083 promising 0.07785492687250702 potent 0.07268429605554735 between 0.07253656374649135 inhibition 0.06943418525631556 vitro 0.06603634214802777 experimental 0.029546461811198108 active 0.022750775594622543 cell 0.018023341704830848 effective 0.006057024671295612 well 0.0033978431082877826 energy 0.0011818584724479244 drug 0.0
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